0  B8R1.4  O=C1CCNC(=O)N1 T4886 [0,0,0,0,0,0|3,0,1]=4
1  B7R1.3  O=C1C=CCCN1 BBP02874 [1,0,0,0,0,0|1,0,2]=4
2  B9R1.3  O=C1NCCC(O)C1Cl BBP02836 [0,1,0,0,0,0|2,0,0]=3
3  B9R1.66  CC1(O)CCOC(=O)C1 T1353 [0,1,0,0,0,0|1,0,0]=2
4  B7R0.2  COC(=O)CC(C)=O T4851 [0,0,1,0,0,0|2,0,1]=4
5  B7R0.4  CCCCCC(=O)O T3944 [0,0,1,0,0,0|1,0,0]=2
6  B7R0.4  NCCCCC(=O)O T5089 [0,0,1,0,0,0|2,0,0]=3
7  B7R1.2  O=C1CCC(O)N1 BBP01947 [0,0,0,0,1,0|2,0,0]=3
8  B7R1.4  N[C@@H]1CONC1=O T1589 [0,0,0,0,1,0|3,0,0]=4
9  B7R1.4  N[C@H]1CONC1=O T0710 [0,0,0,0,1,0|3,0,0]=4
10  B6R0.2  CC(C)CC(N)=O T0361 [1,0,1,0,0,0|1,0,0]=3
11  B6R0.2  CC(O)CC(=O)O T4947 [1,0,1,0,0,0|2,0,0]=4
12  B6R0.4  CCCCC(=O)O T4792 [1,0,1,0,0,0|1,0,0]=3
13  B6R0.4  NCCCC(=O)O T0508 [1,0,1,0,0,0|2,0,0]=4
14  B8R0.2  CC[C@H](C)[C@H](N)C(=O)O T0063 [0,1,1,0,0,0|1,0,0]=3
15  B8R0.23  CC(C)CC(=O)C(=O)O T5071 [0,1,1,0,0,0|1,0,1]=4
16  B8R0.7  CCCCCCC(=O)O T3945 [0,1,1,0,0,0|1,0,0]=3
17  B8R0.8  CCCC[C@H](N)C(=O)O T4765 [0,1,1,0,0,0|1,0,0]=3
18  B8R0.8  CSCCC(N)C(=O)O TJO2742 [0,1,1,0,0,0|2,0,0]=4
19  B8R0.8  CSCC[C@H](N)C(=O)O T4844 [0,1,1,0,0,0|2,0,0]=4
20  B8R0.8  C[Se]CCC(N)C(=O)O T1658 [0,1,1,0,0,0|2,0,0]=4
21  B8R0.8  NCCC[C@@H](N)C(=O)O T0551 [0,1,1,0,0,0|2,0,0]=4
22  B8R0.8  NCCC[C@H](N)C(=O)O T0737 [0,1,1,0,0,0|2,0,0]=4
23  B8R0.8  NCCC[C@H](N)C(=O)O T2O2701 [0,1,1,0,0,0|2,0,0]=4
24  B8R0.9  COC(=O)CCC(C)=O BBP00556 [0,1,1,0,0,0|1,0,1]=4
25  B8R0.3  O=CC[C@H](O)[C@H](O)CO T4818 [0,1,1,0,0,0|2,0,0]=4
26  B8R1.1  COC1CCC(=O)N1 BBP00214 [0,1,0,0,1,0|1,0,0]=3
27  B8R1.1  O=C1CC[C@H](CO)C1 BBP00686 [0,1,0,0,1,0|0,0,0]=2
28  B8R1.7  O=C(O)[C@@H]1CCCN1 BBP00795 [0,0,1,1,0,0|2,0,0]=4
29  B8R1.7  O=C(O)[C@@H]1CCCN1 T2O2683 [0,0,1,1,0,0|2,0,0]=4
30  B6R0.3  CC(CN)C(=O)O T4887 [0,0,1,0,1,0|2,0,0]=4
31  B6R0.3  CCC(O)C(=O)[O-] T4738 [0,0,1,0,1,0|2,0,0]=4
32  B6R1.2  O=C1CCCC1 T4800 [1,0,0,0,1,0|0,0,0]=2